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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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113596 50452099 1 F4O5N6H40C41 A4B5C6D40E41 -314.89 12.29 -9.16 -0.63 0
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113597 50452100 1 F3O5N6C41H41 A3B5C6D41E41 -276.43 5.25 -8.97 -0.51 0
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113598 50452101 1 F3O5N6C42H43 A3B5C6D42E43 -287.15 9.38 -8.79 -0.38 0
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113599 50452102 1 ClF2O5N6C34H35 AB2C5D6E34F35 -257.93 8.28 -9.0 -0.64 0
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113600 50452103 1 ClF2O5N6C36H39 AB2C5D6E36F39 -257.23 3.57 -8.95 -0.52 0
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113601 50452104 1 ClF2O5N6C37H41 AB2C5D6E37F41 -269.13 9.48 -8.88 -0.53 0
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113602 50452105 1 ClF2O5N6C40H45 AB2C5D6E40F45 -274.16 8.69 -8.96 -0.49 0
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113603 50452106 1 ClF2O5N6C41H41 AB2C5D6E41F41 -234.75 5.95 -8.9 -1.06 0
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113604 50452107 1 F2N6O6C41H42 A2B6C6D41E42 -261.85 7.97 -8.58 -0.6 0
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113605 50452108 1 F3O5N6H39C40 A3B5C6D39E40 -261.72 7.76 -8.54 -0.71 0
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113606 50452109 1 F2O5N6C41H42 A2B5C6D41E42 -232.45 3.24 -8.28 -0.49 0
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113607 50452110 1 F2O5N6C41H42 A2B5C6D41E42 -227.36 5.21 -8.18 -0.6 0
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113608 50452111 1 ClF2O5N6H39C40 AB2C5D6E39F40 -229.12 2.35 -8.41 -0.82 0
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113609 50452112 1 F2O5N6C41H42 A2B5C6D41E42 -229.19 5.04 -8.22 -0.54 0
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113610 50452113 1 F2O5N6C40H40 A2B5C6D40E40 -218.71 4.77 -8.3 -0.46 0
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113611 50452114 1 F3O5N6H39C40 A3B5C6D39E40 -265.56 4.06 -8.67 -0.56 0
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113612 50452115 1 F3O5N6H39C40 A3B5C6D39E40 -262.45 6.77 -8.39 -0.66 0
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113613 50452116 1 F2N6O6C41H42 A2B6C6D41E42 -262.88 7.19 -8.28 -0.46 0
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113614 50452117 1 F2O5N6C41H44 A2B5C6D41E44 -240.74 8.83 -8.93 -0.84 0
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113615 50452118 1 FO5N6C41H45 AB5C6D41E45 -207.94 5.0 -8.75 -0.95 0
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113616 50452119 1 F2O5N6C40H42 A2B5C6D40E42 -244.87 2.12 -8.99 -0.88 0
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113617 50452120 1 F3O5N6C40H41 A3B5C6D40E41 -288.3 6.87 -8.84 -1.1 0
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113618 50452121 1 F2O5N6C40H42 A2B5C6D40E42 -237.57 6.68 -8.83 -0.92 0
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113619 50452122 1 F2O5N6C41H44 A2B5C6D41E44 -247.47 8.76 -8.87 -0.97 0
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113620 50452123 1 ClFO5N6C34H38 ABC5D6E34F38 -238.28 13.94 -9.08 -0.52 0